Base information

Cat. No.
CAS No.80448-90-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C99H155N31O23
Molecular Weight 2147.48
Exact Mass 2146.19
XLogP3 6.5165
Mr 563.91
PSA 917.37
Sequence -
Atom number 308
Bond number 312
Ring number 5
Rotor number 90
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CC(=O)N)CC(=O)O)Cc1c[nH]c2c1cccc2)CCCCN)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)N)CC(C)C)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N

Inquiry

We'll get back to you in 1-2 business days.